SCHEMBL29045773

SCHEMBL29045773

Cc1cccc(COc2ccc(OCCOCCNC3CCCC3)cc2)c1

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FOXM1 Q08050 2/20 0.74
▸ SMN1; SMN2 Q16637 2/20 0.57
▸ KDM4E B2RXH2 7/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ CYP1A2 P05177 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ ALDH1A1 P00352 3/20 0.48
▸ MAOB P27338 3/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ HTR2C P28335 2/20 0.42
▸ SLC6A4 P31645 2/20 0.42
▸ HTR2A P28223 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29986250 1.00 FOXM1 (0.74) FOXM1SMN1; SMN2KDM4EKMT2ACYP1A2
SCHEMBL29985891 0.88 FOXM1 (0.73) FOXM1SMN1; SMN2KDM4EKMT2ACYP1A2
SCHEMBL29045830 0.88 FOXM1 (0.73) FOXM1SMN1; SMN2KDM4EKMT2ACYP1A2
SCHEMBL29985464 0.86 FOXM1 (0.74) FOXM1SMN1; SMN2KDM4EKMT2ACYP1A2
SCHEMBL29985851 0.86 FOXM1 (0.74) FOXM1SMN1; SMN2KDM4EKMT2ACYP1A2
SCHEMBL29045821 0.86 FOXM1 (0.74) FOXM1SMN1; SMN2KDM4EKMT2ACYP1A2
SCHEMBL29045816 0.86 FOXM1 (0.74) FOXM1SMN1; SMN2KDM4EKMT2ACYP1A2
SCHEMBL29045805 0.86 FOXM1 (0.77) FOXM1SMN1; SMN2KDM4EKMT2ACYP1A2
SCHEMBL29045813 0.86 FOXM1 (1.00) FOXM1SMN1; SMN2KDM4EKMT2ACYP1A2
SCHEMBL29045845 0.84 FOXM1 (0.97) FOXM1SMN1; SMN2KDM4EKMT2ACYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115304502-A FOXM1 inhibitor and preparation method and application thereof 中国医学科学院医药生物技术研究所 2022-11-08 — — CN disclosed
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